Geometry & MOs

Info

ID:	195805
PubChem CID:	78732806
Reduced:	ClO2N3C20H25 (1)
Stoich.:	AB2C3D20E25 (1)
Weight, g/mol:	373.155705
ΔH_f, kcal/mol:	-29.26
Dipole, Da:	3.84
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.822708
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)Cl)[NH2+]CC(=O)NC2=CC=C(C=C2)N3CCOCC3

DOS

IR

Vibrations