Geometry & MOs

Info

ID:	36338
PubChem CID:	8001854
Reduced:	SN2O3C18H18 (1)
Stoich.:	AB2C3D18E18 (1)
Weight, g/mol:	388.117155
ΔH_f, kcal/mol:	-45.59
Dipole, Da:	1.98
IP(EA), eV:	-8.35(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(1H-indole-3-carbonylamino)carbamoyl]phenyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(OC=C3)C

DOS

IR

Vibrations