Geometry & MOs

Info

ID:	125536
PubChem CID:	50928118
Reduced:	SO2N3H15C16 (1)
Stoich.:	AB2C3D15E16 (1)
Weight, g/mol:	392.075012
ΔH_f, kcal/mol:	22.78
Dipole, Da:	4.76
IP(EA), eV:	-8.77(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chlorophenyl)methyl]-4-phenyl-3-pyrrol-1-ylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=CSC(=C2N3C=CC=C3)C(=O)NN

DOS

IR

Vibrations