Geometry & MOs

Info

ID:	448298
PubChem CID:	135289991
Reduced:	O5H12C13 (1)
Stoich.:	A5B12C13 (1)
Weight, g/mol:	293.162708
ΔH_f, kcal/mol:	-98.95
Dipole, Da:	3.96
IP(EA), eV:	-8.79(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopropylmethoxy)-2-[2-(dimethylamino)ethoxy]-3-methoxybenzaldehyde

Drug info:

PubChemData

Smile

CC(=O)OC1=C(C=CC(=C1OC)OCC#C)C=O

DOS

IR

Vibrations