Geometry & MOs

Info

ID:	368692
PubChem CID:	127329829
Reduced:	O3N5C17H29 (1)
Stoich.:	A3B5C17D29 (1)
Weight, g/mol:	354.183795
ΔH_f, kcal/mol:	-72.88
Dipole, Da:	5.08
IP(EA), eV:	-8.74(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-propan-2-ylmorpholin-2-yl)methyl]-N-(1,3,4-thiadiazol-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)N2CCN(CC2)CC3CN(CCO3)C(C)C

DOS

IR

Vibrations