Geometry & MOs

Info

ID:	355933
PubChem CID:	127290785
Reduced:	O3N4C19H30 (1)
Stoich.:	A3B4C19D30 (1)
Weight, g/mol:	284.138559
ΔH_f, kcal/mol:	-119.14
Dipole, Da:	6.11
IP(EA), eV:	-9.34(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(1-phenyltetrazol-5-yl)ethyl]morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)C2CCN(CC2)C(=O)CN3CCOC(C3)C#N

DOS

IR

Vibrations