Geometry & MOs

Info

ID:	178906
PubChem CID:	76399898
Reduced:	ON6C20H26 (1)
Stoich.:	AB6C20D26 (1)
Weight, g/mol:	365.221561
ΔH_f, kcal/mol:	40.47
Dipole, Da:	6.03
IP(EA), eV:	-8.95(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(benzimidazol-1-ylmethyl)-N-[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]pyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1CNNC1C2CCCN(C2)C(=O)C3=CN=C(N=C3)C4=CN=CC=C4

DOS

IR

Vibrations