Geometry & MOs

Info

ID:	335631
PubChem CID:	127254493
Reduced:	ON7C13H21 (1)
Stoich.:	AB7C13D21 (1)
Weight, g/mol:	304.132411
ΔH_f, kcal/mol:	48.76
Dipole, Da:	8.69
IP(EA), eV:	-9.38(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-indol-1-ylethyl)-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)NCCCN1C=CN=C1)N2C=NN=N2

DOS

IR

Vibrations