Geometry & MOs

Info

ID:	59107
PubChem CID:	24770979
Reduced:	ClO3N4H11C20 (1)
Stoich.:	AB3C4D11E20 (1)
Weight, g/mol:	284.152478
ΔH_f, kcal/mol:	66.28
Dipole, Da:	5.59
IP(EA), eV:	-8.94(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[5-(3-methoxyphenyl)pyridin-3-yl]oxymethyl]cyclopropyl]methanamine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(N4C=C(C=CC4=N3)Cl)N(C2=O)C5=CC=C(C=C5)[N+](=O)[O-]

DOS

IR

Vibrations