Geometry & MOs

Info

ID:	387447
PubChem CID:	134985407
Reduced:	N2O2C5H8 (1)
Stoich.:	A2B2C5D8 (1)
Weight, g/mol:	366.194343
ΔH_f, kcal/mol:	34.46
Dipole, Da:	3.94
IP(EA), eV:	-9.21(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-6-nitro-1,5-diphenyl-3-(propan-2-ylamino)hept-2-en-1-one

Drug info:

PubChemData

Smile

C1C[C@H]([C@H](C1)N=O)N=O

DOS

IR

Vibrations