Geometry & MOs

Info

ID:	358276
PubChem CID:	127295821
Reduced:	ON5C18H29 (1)
Stoich.:	AB5C18D29 (1)
Weight, g/mol:	387.263425
ΔH_f, kcal/mol:	-39.38
Dipole, Da:	5.45
IP(EA), eV:	-8.78(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(CC1)C2CCN(C2)C(=O)NCC3=CN4CCCCC4=N3

DOS

IR

Vibrations