Geometry & MOs

Info

ID:

173361

PubChem CID:

75627798

Reduced:

NO6H47C53 (1)

Stoich.:

AB6C47D53 (1)

Weight, g/mol:

651.269299

ΔHf, kcal/mol:

-68.31

Dipole, Da:

3.49

IP(EA), eV:

 -8.31(-0.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-[(4-methylphenyl)methoxy]phenyl]methyl 5-[[amino(nitramido)methylidene]amino]-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)COC2=CC=C(C=C2)COC(=O)C(CCOC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)NC(=O)OCC6C7=CC=CC=C7C8=CC=CC=C68

DOS

IR

Vibrations