Geometry & MOs

Info

ID:	264075
PubChem CID:	103425313
Reduced:	OSN3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	309.187484
ΔH_f, kcal/mol:	-12.24
Dipole, Da:	6.39
IP(EA), eV:	-8.12(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-cyclopropyl-5-(3-methylbutylamino)-N-propylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCCCNC1=C(C(=C(S1)C(=O)NC2CC2)N)C3CC3

DOS

IR

Vibrations