Geometry & MOs

Info

ID:	365369
PubChem CID:	127317768
Reduced:	N3O4C20H29 (1)
Stoich.:	A3B4C20D29 (1)
Weight, g/mol:	323.177982
ΔH_f, kcal/mol:	-172.53
Dipole, Da:	3.0
IP(EA), eV:	-8.15(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-cyclobutylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCOC1)CNC(=O)NC2=CC3=C(C=C2)OCCN3C(=O)C(C)(C)C

DOS

IR

Vibrations