Geometry & MOs

Info

ID:	342522
PubChem CID:	127265677
Reduced:	N2O3C19H20 (1)
Stoich.:	A2B3C19D20 (1)
Weight, g/mol:	283.14331
ΔH_f, kcal/mol:	-71.41
Dipole, Da:	4.4
IP(EA), eV:	-8.26(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[5-(2-phenylethenyl)tetrazol-1-yl]methyl]piperidin-2-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1NC(=O)C3CCN(C4=CC=CC=C34)C)OCO2

DOS

IR

Vibrations