Geometry & MOs

Info

ID:	368103
PubChem CID:	127327479
Reduced:	F3N7C14H14 (1)
Stoich.:	A3B7C14D14 (1)
Weight, g/mol:	373.19026
ΔH_f, kcal/mol:	-17.18
Dipole, Da:	10.29
IP(EA), eV:	-9.38(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydroindol-1-yl-[6-[3-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]pyridin-3-yl]methanone

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCN(C2)C3=NN4C(=NN=C4C(F)(F)F)C=C3

DOS

IR

Vibrations