Geometry & MOs

Info

ID:	310292
PubChem CID:	126578107
Reduced:	N2C11H22 (1)
Stoich.:	A2B11C22 (1)
Weight, g/mol:	347.232125
ΔH_f, kcal/mol:	-18.62
Dipole, Da:	1.31
IP(EA), eV:	-8.55(2.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[4-[5-(4-methylcyclohexyl)-1,2,4-triazin-3-yl]piperazin-1-yl]acetate

Drug info:

PubChemData

Smile

CNC12CCC(CC1)(CC2)N(C)C

DOS

IR

Vibrations