Geometry & MOs

Info

ID:	273152
PubChem CID:	103770587
Reduced:	SN2O2C16H22 (1)
Stoich.:	AB2C2D16E22 (1)
Weight, g/mol:	277.204179
ΔH_f, kcal/mol:	-62.26
Dipole, Da:	6.83
IP(EA), eV:	-9.34(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethyl-2-hydroxypentyl)-2-methyl-2-phenylpropanamide

Drug info:

PubChemData

Smile

CCC(CC)C(CNC(=O)C1=CC=CC=C1SCC#N)O

DOS

IR

Vibrations