Geometry & MOs

Info

ID:	153109
PubChem CID:	56312243
Reduced:	O2S2N3C22H25 (1)
Stoich.:	A2B2C3D22E25 (1)
Weight, g/mol:	381.132254
ΔH_f, kcal/mol:	-21.47
Dipole, Da:	5.92
IP(EA), eV:	-8.18(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[2-[2,2-difluoroethyl(propyl)amino]acetyl]amino]phenyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)CN(CC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C(C)C

DOS

IR

Vibrations