Geometry & MOs

Info

ID:	402107
PubChem CID:	135054400
Reduced:	NO4C17H21 (1)
Stoich.:	AB4C17D21 (1)
Weight, g/mol:	222.089209
ΔH_f, kcal/mol:	-169.03
Dipole, Da:	5.47
IP(EA), eV:	-9.83(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7-dimethoxy-3,4-dihydro-2H-chromene-4-carbaldehyde

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=CC=C1)C(=O)C)C(=O)N2[C@@H](COC2=O)C(C)C

DOS

IR

Vibrations