Geometry & MOs

Info

ID:	371419
PubChem CID:	127346292
Reduced:	ClN3O3C18H24 (1)
Stoich.:	AB3C3D18E24 (1)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-131.05
Dipole, Da:	1.21
IP(EA), eV:	-8.92(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-2-(oxolan-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C(=O)CC3CCOC3)Cl

DOS

IR

Vibrations