Geometry & MOs

Info

ID:	222528
PubChem CID:	85305421
Reduced:	NSiO5C18H21 (1)
Stoich.:	ABC5D18E21 (1)
Weight, g/mol:	362.209324
ΔH_f, kcal/mol:	-76.35
Dipole, Da:	4.47
IP(EA), eV:	-9.97(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(hydroxymethyl)-5,5-dimethyl-4-phenylmethoxyspiro[1,3,3a,4,6,6a-hexahydropentalene-2,2'-1,3-dioxolane]-1-yl]methanol

Drug info:

PubChemData

Smile

CC12C(CCC1(O2)C#C[Si](C)(C)C)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations