Geometry & MOs

Info

ID:	362544
PubChem CID:	127308159
Reduced:	ClON3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	309.15896
ΔH_f, kcal/mol:	-36.94
Dipole, Da:	2.9
IP(EA), eV:	-8.65(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-(2,3-dihydroindol-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)N2CCN3CCCC3C2)Cl

DOS

IR

Vibrations