Geometry & MOs

Info

ID:	204632
PubChem CID:	79989764
Reduced:	NSO2C15H19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	353.94962
ΔH_f, kcal/mol:	-23.06
Dipole, Da:	5.81
IP(EA), eV:	-9.16(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(2-carbamothioylphenyl)-4-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CC1CN(C)C(=O)C2=CC(=C(S2)C#CCO)C

DOS

IR

Vibrations