Geometry & MOs

Info

ID:	265487
PubChem CID:	103525075
Reduced:	NO4C13H23 (1)
Stoich.:	AB4C13D23 (1)
Weight, g/mol:	233.14495
ΔH_f, kcal/mol:	-197.65
Dipole, Da:	4.43
IP(EA), eV:	-9.69(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-hydroxypropylsulfanyl)ethyl]-3-methylpentanamide

Drug info:

PubChemData

Smile

CC1(OCC(O1)CNC(=O)CC2(CCC2)OC)C

DOS

IR

Vibrations