Geometry & MOs

Info

ID:	273474
PubChem CID:	103771182
Reduced:	SN3O3C12H25 (1)
Stoich.:	AB3C3D12E25 (1)
Weight, g/mol:	279.183444
ΔH_f, kcal/mol:	-172.54
Dipole, Da:	6.0
IP(EA), eV:	-8.79(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-3-(2-methoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C(CCSC)NC(=O)N)O

DOS

IR

Vibrations