Geometry & MOs

Info

ID:	206842
PubChem CID:	80307931
Reduced:	SO2N3C10H17 (1)
Stoich.:	AB2C3D10E17 (1)
Weight, g/mol:	313.06774
ΔH_f, kcal/mol:	-58.73
Dipole, Da:	1.62
IP(EA), eV:	-9.98(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)-N-(2-ethyl-4-hydroxybutyl)acetamide

Drug info:

PubChemData

Smile

CCC(CCO)CNC(=O)C1=C(N=NS1)C

DOS

IR

Vibrations