Geometry & MOs

Info

ID:	426692
PubChem CID:	135153389
Reduced:	N2O3C19H30 (1)
Stoich.:	A2B3C19D30 (1)
Weight, g/mol:	361.236542
ΔH_f, kcal/mol:	-139.17
Dipole, Da:	5.08
IP(EA), eV:	-8.45(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[cyclohexyl(2-methylpropyl)amino]-3-nitrophenyl]butanamide

Drug info:

PubChemData

Smile

C[C@H](CC(=O)O)C1=CC(=C(C=C1)N(CC(C)C)C2CCOCC2)N

DOS

IR

Vibrations