Geometry & MOs

Info

ID:	309826
PubChem CID:	126561063
Reduced:	N5C14H15 (1)
Stoich.:	A5B14C15 (1)
Weight, g/mol:	505.259009
ΔH_f, kcal/mol:	93.03
Dipole, Da:	2.72
IP(EA), eV:	-8.86(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[(3Z)-3-(4-piperidin-1-ylpyrrolo[2,3-c]pyridin-2-ylidene)-1,2-dihydroindazol-5-yl]pyridin-3-yl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NC(=N1)C2=CC=CN2C)C3=CC=CN3C

DOS

IR

Vibrations