Geometry & MOs

Info

ID:	297042
PubChem CID:	117606770
Reduced:	O5C18H24 (1)
Stoich.:	A5B18C24 (1)
Weight, g/mol:	250.120509
ΔH_f, kcal/mol:	-207.93
Dipole, Da:	5.0
IP(EA), eV:	-9.44(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5R)-4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]acetaldehyde

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/C[C@@H]1COC(OC1C2=CC=CC=C2O)(C)C

DOS

IR

Vibrations