Geometry & MOs

Info

ID:	183048
PubChem CID:	76971086
Reduced:	N2O2C11H14 (2)
Stoich.:	A2B2C11D14 (2)
Weight, g/mol:	678.627459
ΔH_f, kcal/mol:	-156.94
Dipole, Da:	9.6
IP(EA), eV:	-9.37(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-[(2R)-2-hydroxypropyl]octadec-9-enamide;(Z)-N-[(2S)-2-hydroxypropyl]octadec-9-enamide

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=CC=C1)C(=O)NC(=O)N.CC[C@@H](C1=CC=CC=C1)C(=O)NC(=O)N

DOS

IR

Vibrations