Geometry & MOs

Info

ID:	136231
PubChem CID:	52003479
Reduced:	N3O4C21H25 (1)
Stoich.:	A3B4C21D25 (1)
Weight, g/mol:	362.174276
ΔH_f, kcal/mol:	-87.92
Dipole, Da:	7.04
IP(EA), eV:	-8.06(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1H-indol-3-yl)ethyl]-3-(5-methoxyindazol-1-yl)propanamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N(N=C2)CCC(=O)NCCC3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations