Geometry & MOs

Info

ID:	145429
PubChem CID:	53523759
Reduced:	OSN2C12H22 (1)
Stoich.:	ABC2D12E22 (1)
Weight, g/mol:	231.148396
ΔH_f, kcal/mol:	-62.72
Dipole, Da:	4.34
IP(EA), eV:	-8.5(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(1-phenyltetrazol-5-yl)methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCC1)N2CCSCC2

DOS

IR

Vibrations