Geometry & MOs

Info

ID:	273747
PubChem CID:	103799512
Reduced:	N3O4C11H19 (1)
Stoich.:	A3B4C11D19 (1)
Weight, g/mol:	302.066949
ΔH_f, kcal/mol:	-131.33
Dipole, Da:	5.55
IP(EA), eV:	-10.13(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(4-hydroxy-1-methoxybutan-2-yl)-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCC(=O)NC(CCO)COC

DOS

IR

Vibrations