Geometry & MOs

Info

ID:	390128
PubChem CID:	134997240
Reduced:	O3C8H10 (2)
Stoich.:	A3B8C10 (2)
Weight, g/mol:	275.152144
ΔH_f, kcal/mol:	-241.31
Dipole, Da:	3.95
IP(EA), eV:	-8.76(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]but-3-enyl]-1-phenylmethanimine oxide

Drug info:

PubChemData

Smile

C[C@H]1[C@H](C(=O)O[C@H]1OC(=O)C)COCC2=CC=C(C=C2)OC

DOS

IR

Vibrations