Geometry & MOs

Info

ID:	403031
PubChem CID:	135058421
Reduced:	SN2C22H30 (1)
Stoich.:	AB2C22D30 (1)
Weight, g/mol:	315.162314
ΔH_f, kcal/mol:	19.33
Dipole, Da:	1.37
IP(EA), eV:	-8.77(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-methoxy-2-[[(1S,2S)-2-phenylcyclopropyl]methyl]phenyl]pyridine

Drug info:

PubChemData

Smile

C1CCC(CC1)C(C2=CSC(=N2)C3=CC=CC=C3)NC4CCCCC4

DOS

IR

Vibrations