Geometry & MOs

Info

ID:	231274
PubChem CID:	87573323
Reduced:	N2O7C20H20 (1)
Stoich.:	A2B7C20D20 (1)
Weight, g/mol:	456.167666
ΔH_f, kcal/mol:	-228.14
Dipole, Da:	7.36
IP(EA), eV:	-11.47(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[1-[[6-chloro-5-[4-(2H-tetrazol-5-yl)phenyl]pyridin-3-yl]oxymethyl]cyclopropyl]-2,2-dimethylpropyl]carbamic acid

Drug info:

PubChemData

Smile

C1C2CC(C1C#N)C(C2C(=O)OC(=O)C3C4CC(C(C4)C3C(=O)O)C#N)C(=O)O

DOS

IR

Vibrations