Geometry & MOs

Info

ID:	188649
PubChem CID:	77747771
Reduced:	N5O6C19H21 (1)
Stoich.:	A5B6C19D21 (1)
Weight, g/mol:	394.196421
ΔH_f, kcal/mol:	-158.22
Dipole, Da:	4.85
IP(EA), eV:	-9.49(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[tert-butyl(diphenyl)silyl]oxybicyclo[3.1.0]hexane-3-carboxylate

Drug info:

PubChemData

Smile

CCN(C1=CC=C(C=C1)C(=O)O)C(=O)CCN2CN=C3C2=NC=NC3=O.CC(=O)O

DOS

IR

Vibrations