Geometry & MOs

Info

ID:	21754
PubChem CID:	589778
Reduced:	SN3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	283.114319
ΔH_f, kcal/mol:	82.34
Dipole, Da:	4.7
IP(EA), eV:	-8.32(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-4-(5-phenyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)aniline

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C2NN=C(S2)C3=CC=CC=C3

DOS

IR

Vibrations