Geometry & MOs

Info

ID:	60904
PubChem CID:	26703021
Reduced:	FSN3O3C16H16 (1)
Stoich.:	ABC3D3E16F16 (1)
Weight, g/mol:	489.116998
ΔH_f, kcal/mol:	-130.97
Dipole, Da:	4.36
IP(EA), eV:	-8.82(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-[4-(difluoromethoxy)-3-(4-methoxyphenyl)anilino]-2-oxoethyl]amino]-2-oxoethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)NC(=O)CNC(=O)CNC(=O)C2=CC=CS2

DOS

IR

Vibrations