Geometry & MOs

Info

ID:	54064
PubChem CID:	14719888
Reduced:	SN3O3C20H35 (1)
Stoich.:	AB3C3D20E35 (1)
Weight, g/mol:	351.204573
ΔH_f, kcal/mol:	-105.68
Dipole, Da:	5.34
IP(EA), eV:	-8.5(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(diethoxymethyl)-2-[(E)-4-(oxan-2-yloxy)but-2-enoxy]pyridine

Drug info:

PubChemData

Smile

CC(C)COCC(CN1CCN(CC1)S(=O)(=O)C)N(C)CC2=CC=CC=C2

DOS

IR

Vibrations