Geometry & MOs

Info

ID:	141584
PubChem CID:	52897973
Reduced:	O3N4C16H18 (1)
Stoich.:	A3B4C16D18 (1)
Weight, g/mol:	367.062677
ΔH_f, kcal/mol:	-20.93
Dipole, Da:	7.93
IP(EA), eV:	-9.46(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[(2Z)-2-cyano-2-(1-methyl-2-oxoindol-3-ylidene)acetyl]amino]thiophene-2-carboxylate

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CN[C@H]2C(=NCC3=CC=NC=C3)C(=O)C2=O

DOS

IR

Vibrations