Geometry & MOs

Info

ID:	383775
PubChem CID:	134975698
Reduced:	OC3H3 (4)
Stoich.:	AB3C3 (4)
Weight, g/mol:	264.077789
ΔH_f, kcal/mol:	-144.87
Dipole, Da:	3.99
IP(EA), eV:	-9.38(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-2-(1-propan-2-yltetrazol-5-yl)ethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(=O)CC(=O)CC(=O)O

DOS

IR

Vibrations