Geometry & MOs

Info

ID:	422534
PubChem CID:	135118002
Reduced:	N2O7C26H32 (1)
Stoich.:	A2B7C26D32 (1)
Weight, g/mol:	309.107319
ΔH_f, kcal/mol:	-204.13
Dipole, Da:	3.2
IP(EA), eV:	-8.38(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5R)-3-[3-(5-methyltetrazol-1-yl)propanoyl]-3-azabicyclo[3.1.0]hexane-1,5-dicarboxylic acid

Drug info:

PubChemData

Smile

COCC(=O)N1CCOCCOC2=CC=C(C=C2)C3C4=CC(=C(C=C4CCN3C(=O)C1)OC)OC

DOS

IR

Vibrations