Geometry & MOs

Info

ID:	332023
PubChem CID:	127250309
Reduced:	N2O2C11H13 (2)
Stoich.:	A2B2C11D13 (2)
Weight, g/mol:	385.155705
ΔH_f, kcal/mol:	-110.45
Dipole, Da:	3.54
IP(EA), eV:	-9.11(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[5-(3-chlorophenyl)pyridin-2-yl]morpholin-4-yl]-2-pyrrolidin-1-ylethanone

Drug info:

PubChemData

Smile

C1COCCN1CC(=O)N2CCOC(C2)C3=NC=C(C=C3)C4=CC=C(C=C4)C(=O)N

DOS

IR

Vibrations