Geometry & MOs

Info

ID:	371204
PubChem CID:	127344321
Reduced:	ON5C19H31 (1)
Stoich.:	AB5C19D31 (1)
Weight, g/mol:	345.252861
ΔH_f, kcal/mol:	-39.11
Dipole, Da:	4.49
IP(EA), eV:	-8.62(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopentyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-ylmethyl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN2C=C(N=C2C1)CNC(=O)N3CCCC(CC3)N4CCCC4

DOS

IR

Vibrations