Geometry & MOs

Info

ID:	208978
PubChem CID:	80608951
Reduced:	SN5C10H19 (1)
Stoich.:	AB5C10D19 (1)
Weight, g/mol:	283.183067
ΔH_f, kcal/mol:	42.52
Dipole, Da:	4.73
IP(EA), eV:	-8.42(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propyl-5-[(3,3,4-trimethylpiperazin-1-yl)methyl]-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CC1(CN(CCN1C)CC2=NN=C(S2)N)C

DOS

IR

Vibrations