Geometry & MOs

Info

ID:	39241
PubChem CID:	8139967
Reduced:	ClO2N3C19H22 (1)
Stoich.:	AB2C3D19E22 (1)
Weight, g/mol:	370.146347
ΔH_f, kcal/mol:	-49.51
Dipole, Da:	6.17
IP(EA), eV:	-9.4(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxy-5-methylphenyl)-5-[3-(3-methylphenoxy)propylsulfanyl]tetrazole

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)CNC(=O)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations