Geometry & MOs

Info

ID:	441921
PubChem CID:	135246720
Reduced:	NO2C12H13 (2)
Stoich.:	AB2C12D13 (2)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	-77.79
Dipole, Da:	2.36
IP(EA), eV:	-8.76(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-[2-[4-[1-(methoxymethyl)cyclopropyl]phenoxy]pyridin-3-yl]pyridine

Drug info:

PubChemData

Smile

CC=NC1=C(CCCC1OC(=O)C)/C=C/OC2=C(C=CC=N2)C3=CC=CC=C3OC

DOS

IR

Vibrations