Geometry & MOs

Info

ID:	280708
PubChem CID:	103850848
Reduced:	N2O4C11H18 (1)
Stoich.:	A2B4C11D18 (1)
Weight, g/mol:	302.066949
ΔH_f, kcal/mol:	-158.01
Dipole, Da:	4.98
IP(EA), eV:	-9.65(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)C)C(=O)NC(CCO)COC

DOS

IR

Vibrations