Geometry & MOs

Info

ID:	30270
PubChem CID:	841067
Reduced:	N2O3C19H22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	337.053942
ΔH_f, kcal/mol:	-57.0
Dipole, Da:	6.84
IP(EA), eV:	-8.28(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3-chlorobenzoyl)amino]-5-propan-2-ylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C=NNC(=O)C2=CC(=C(C=C2)C)C)OC

DOS

IR

Vibrations