Geometry & MOs

Info

ID:	268158
PubChem CID:	103598138
Reduced:	OSN2C19H22 (1)
Stoich.:	ABC2D19E22 (1)
Weight, g/mol:	359.19574
ΔH_f, kcal/mol:	8.17
Dipole, Da:	4.46
IP(EA), eV:	-9.13(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxyphenyl)-N-[2-(2-methylpropoxy)ethyl]-2-(5-methyltetrazol-1-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C=CC(=O)N2CCCC2CCC3=CC=CC=C3

DOS

IR

Vibrations