Geometry & MOs

Info

ID:	171790
PubChem CID:	75428170
Reduced:	O2N3C19H25 (1)
Stoich.:	A2B3C19D25 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-50.53
Dipole, Da:	6.67
IP(EA), eV:	-8.56(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyano-2-methylphenyl)-2-(hydroxymethyl)-5-methylmorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)CC(C)NCCOC2=CN=CC=C2)C

DOS

IR

Vibrations