Geometry & MOs

Info

ID:	391409
PubChem CID:	135004834
Reduced:	N3O5C26H27 (1)
Stoich.:	A3B5C26D27 (1)
Weight, g/mol:	274.113984
ΔH_f, kcal/mol:	-119.16
Dipole, Da:	7.4
IP(EA), eV:	-8.61(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-butyl-4-phenylthiophene-3-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(C(=C(C1C2=CC=C(C=C2)OC)C#N)N)C3=CC=CC=C3C)C(=O)OCC

DOS

IR

Vibrations