Geometry & MOs

Info

ID:	70846
PubChem CID:	48413946
Reduced:	O2N3C18H25 (1)
Stoich.:	A2B3C18D25 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	-55.59
Dipole, Da:	5.81
IP(EA), eV:	-8.85(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-oxo-1,5,6,7-tetrahydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C(C)OC2=CC=C(C=C2)C(C)(C)C

DOS

IR

Vibrations