Geometry & MOs

Info

ID:	24664
PubChem CID:	612036
Reduced:	BrSN2C9H11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	257.98263
ΔH_f, kcal/mol:	47.42
Dipole, Da:	5.41
IP(EA), eV:	-8.77(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-bromophenyl)-N,N-dimethylcarbamimidothioic acid

Drug info:

PubChemData

Smile

CN(C)C(=NC1=CC=C(C=C1)Br)S

DOS

IR

Vibrations