Geometry & MOs

Info

ID:	405890
PubChem CID:	135075889
Reduced:	NSiO2C20H27 (1)
Stoich.:	ABC2D20E27 (1)
Weight, g/mol:	230.13068
ΔH_f, kcal/mol:	-81.24
Dipole, Da:	1.96
IP(EA), eV:	-9.26(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-phenylcyclobutyl)-4,7-dihydro-1,3-dioxepine

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)[Si](C2=CC=CC=N2)(C(C)C)C(C)C

DOS

IR

Vibrations