Geometry & MOs

Info

ID:	171597
PubChem CID:	75401118
Reduced:	O3N4C15H18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	323.163377
ΔH_f, kcal/mol:	-100.85
Dipole, Da:	3.22
IP(EA), eV:	-8.79(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(furan-2-yl)azepan-1-yl]-(5-methylimidazo[1,5-a]pyridin-6-yl)methanone

Drug info:

PubChemData

Smile

CN1CN(CC1=O)C(=O)CCCC2=CC3=C(C=C2)NC(=O)N3

DOS

IR

Vibrations