Geometry & MOs

Info

ID:	273629
PubChem CID:	103771520
Reduced:	NO4C16H19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	296.137222
ΔH_f, kcal/mol:	-155.24
Dipole, Da:	5.63
IP(EA), eV:	-9.78(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-4-methoxy-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC2=CC=CC=C2OC1=O)O

DOS

IR

Vibrations