Geometry & MOs

Info

ID:	273308
PubChem CID:	103770878
Reduced:	NSO2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	300.087685
ΔH_f, kcal/mol:	-91.88
Dipole, Da:	4.04
IP(EA), eV:	-9.24(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(2-hydroxy-4-methylpentyl)-4-nitrobenzamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC2=C(S1)CCC2)O

DOS

IR

Vibrations