Geometry & MOs

Info

ID:	311131
PubChem CID:	126589525
Reduced:	NOC10H17 (1)
Stoich.:	ABC10D17 (1)
Weight, g/mol:	581.248563
ΔH_f, kcal/mol:	-28.16
Dipole, Da:	2.51
IP(EA), eV:	-8.73(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[[2-[[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxobutanoate

Drug info:

PubChemData

Smile

CC/C=C\C=C(/C)\C[C@@H](C=O)N

DOS

IR

Vibrations