Geometry & MOs

Info

ID:	337684
PubChem CID:	127258307
Reduced:	ON3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	282.148061
ΔH_f, kcal/mol:	-4.92
Dipole, Da:	4.89
IP(EA), eV:	-8.7(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2Z)-2-(1,2-dihydropyrazol-3-ylidene)indol-4-yl]-3-methylbutanamide

Drug info:

PubChemData

Smile

C/C(=N\N(C)C)/CC(=O)NC1=CC=CC=C1

DOS

IR

Vibrations