Geometry & MOs

Info

ID:	27756
PubChem CID:	823445
Reduced:	OS2N3H11C15 (1)
Stoich.:	AB2C3D11E15 (1)
Weight, g/mol:	305.065654
ΔH_f, kcal/mol:	53.12
Dipole, Da:	3.75
IP(EA), eV:	-8.76(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(dimethylamino)phenyl]carbamothioyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC3=CC=CC=C3S2

DOS

IR

Vibrations