Geometry & MOs

Info

ID:	26485
PubChem CID:	650043
Reduced:	NO3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	315.169525
ΔH_f, kcal/mol:	-170.72
Dipole, Da:	2.02
IP(EA), eV:	-9.64(1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(benzotriazol-1-yl)piperidin-1-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CCC1CCC2(CC1)NC(CO2)(CO)CO

DOS

IR

Vibrations