Geometry & MOs

Info

ID:	206728
PubChem CID:	80290643
Reduced:	NO3C10H21 (1)
Stoich.:	AB3C10D21 (1)
Weight, g/mol:	302.093643
ΔH_f, kcal/mol:	-155.38
Dipole, Da:	2.2
IP(EA), eV:	-9.43(1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-hydroxypentan-2-yl)-2-methyl-4-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CCC(CCO)CNC1COCC1O

DOS

IR

Vibrations