Geometry & MOs

Info

ID:	331844
PubChem CID:	127250130
Reduced:	ClN2O2H21C23 (1)
Stoich.:	AB2C2D21E23 (1)
Weight, g/mol:	392.129156
ΔH_f, kcal/mol:	-12.46
Dipole, Da:	0.53
IP(EA), eV:	-9.13(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[5-[(3-chlorophenyl)methyl]pyridin-2-yl]morpholin-4-yl]-phenylmethanone

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CC=CC=C2)C3=NC=C(C=C3)CC4=CC=CC=C4Cl

DOS

IR

Vibrations