Geometry & MOs

Info

ID:	65766
PubChem CID:	46386841
Reduced:	ClON4H17C21 (1)
Stoich.:	ABC4D17E21 (1)
Weight, g/mol:	354.124739
ΔH_f, kcal/mol:	40.31
Dipole, Da:	1.6
IP(EA), eV:	-8.47(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-chloro-2-pyridin-4-yl-1H-indol-3-yl)-3-cyclopentylurea

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)NC2=C(NC3=C2C=CC=C3Cl)C4=CC=NC=C4

DOS

IR

Vibrations