Geometry & MOs

Info

ID:	369983
PubChem CID:	127337046
Reduced:	O2S2N5C15H25 (1)
Stoich.:	A2B2C5D15E25 (1)
Weight, g/mol:	339.172896
ΔH_f, kcal/mol:	-48.19
Dipole, Da:	4.0
IP(EA), eV:	-8.38(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(oxan-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCSC1=NN=C(S1)NC(=O)N2CCN(CC2)CC3CCOCC3

DOS

IR

Vibrations