Geometry & MOs

Info

ID:	40425
PubChem CID:	8144100
Reduced:	O3N4C22H26 (1)
Stoich.:	A3B4C22D26 (1)
Weight, g/mol:	379.080435
ΔH_f, kcal/mol:	-66.62
Dipole, Da:	4.29
IP(EA), eV:	-8.15(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(Z)-[(4-nitrobenzoyl)hydrazinylidene]methyl]phenyl] furan-2-carboxylate

Drug info:

PubChemData

Smile

C[C@]1(C(=O)N(C(=O)N1)CN2CCN(CC2)C3=CC=CC=C3)C4=CC(=CC=C4)OC

DOS

IR

Vibrations