Geometry & MOs

Info

ID:	406532
PubChem CID:	135077965
Reduced:	ON3H9C10 (1)
Stoich.:	AB3C9D10 (1)
Weight, g/mol:	202.084124
ΔH_f, kcal/mol:	32.8
Dipole, Da:	5.65
IP(EA), eV:	-9.23(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,4S,6R,6aS)-4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-6-carbaldehyde

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NNC(=O)N=C2

DOS

IR

Vibrations