Geometry & MOs

Info

ID:	44962
PubChem CID:	10506850
Reduced:	N3O4C34H35 (1)
Stoich.:	A3B4C34D35 (1)
Weight, g/mol:	550.258006
ΔH_f, kcal/mol:	-81.44
Dipole, Da:	5.1
IP(EA), eV:	-8.77(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1S,2R,3R)-1,2,3,4-tetrakis(phenylmethoxy)butyl]tetrazole

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(C(=C(C1C2=CC=C(C=C2)C)C(=O)OCC)C)CN3C4=CC=CC=C4N=C3C5=CC=CC=C5)C

DOS

IR

Vibrations