Geometry & MOs

Info

ID:	273743
PubChem CID:	103799505
Reduced:	NO3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	301.098394
ΔH_f, kcal/mol:	-134.96
Dipole, Da:	3.62
IP(EA), eV:	-9.99(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)-4-methylsulfonylbenzamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)CCC=C

DOS

IR

Vibrations