Geometry & MOs

Info

ID:	50323
PubChem CID:	12012842
Reduced:	SO3N4C15H26 (1)
Stoich.:	AB3C4D15E26 (1)
Weight, g/mol:	294.111676
ΔH_f, kcal/mol:	-123.99
Dipole, Da:	2.64
IP(EA), eV:	-9.09(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(3-methoxyphenyl)methyl]tetrazol-5-yl]-phenylmethanone

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NN1C(=O)CN(C1=S)CCC2CCCCN2

DOS

IR

Vibrations