Geometry & MOs

Info

ID:	24750
PubChem CID:	612976
Reduced:	SN3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	219.083019
ΔH_f, kcal/mol:	53.5
Dipole, Da:	4.09
IP(EA), eV:	-8.39(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethylphenyl)-5-methyl-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC2=NN=C(S2)C)C

DOS

IR

Vibrations