Geometry & MOs

Info

ID:	280712
PubChem CID:	103850861
Reduced:	NSO5C8H17 (1)
Stoich.:	ABC5D8E17 (1)
Weight, g/mol:	253.131408
ΔH_f, kcal/mol:	-238.9
Dipole, Da:	2.53
IP(EA), eV:	-10.0(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)-2-(4-hydroxyphenyl)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations