Geometry & MOs

Info

ID:	362701
PubChem CID:	127309135
Reduced:	FN2O2C17H21 (1)
Stoich.:	AB2C2D17E21 (1)
Weight, g/mol:	341.165188
ΔH_f, kcal/mol:	-42.63
Dipole, Da:	4.95
IP(EA), eV:	-9.48(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2C(=O)NC3CCC4=C3C=CC=C4F)O

DOS

IR

Vibrations