Geometry & MOs

Info

ID:	68951
PubChem CID:	46513481
Reduced:	ClSO3N4C21H23 (1)
Stoich.:	ABC3D4E21F23 (1)
Weight, g/mol:	427.189592
ΔH_f, kcal/mol:	-101.42
Dipole, Da:	2.04
IP(EA), eV:	-9.2(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCC2(C1)C(=O)N(C(=O)N2)CCCC(=O)NC3=NC=C(S3)CC4=CC=CC=C4Cl

DOS

IR

Vibrations