Geometry & MOs

Info

ID:	70739
PubChem CID:	48413801
Reduced:	N3O3C19H19 (1)
Stoich.:	A3B3C19D19 (1)
Weight, g/mol:	407.141596
ΔH_f, kcal/mol:	-30.51
Dipole, Da:	5.49
IP(EA), eV:	-8.89(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-indol-3-yl)-1-[(5-methyl-1H-pyrazol-4-yl)methylamino]-1-oxopropan-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)COC2=CC=C(C=C2)OC3=CC=CC=C3

DOS

IR

Vibrations