Geometry & MOs

Info

ID:	384002
PubChem CID:	134976148
Reduced:	NO4C25H25 (1)
Stoich.:	AB4C25D25 (1)
Weight, g/mol:	736.35526
ΔH_f, kcal/mol:	-66.47
Dipole, Da:	7.51
IP(EA), eV:	-8.55(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O)N(CC#CC1=C2C=CC=CC2=CC3=CC=CC=C31)OC(=O)C(C)(C)C

DOS

IR

Vibrations