Geometry & MOs

Info

ID:	217111
PubChem CID:	85087273
Reduced:	NO2C22H23 (1)
Stoich.:	AB2C22D23 (1)
Weight, g/mol:	333.209264
ΔH_f, kcal/mol:	14.32
Dipole, Da:	2.66
IP(EA), eV:	-9.49(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methoxyphenyl)methyl]-3,4-dimethyl-1-(1-phenylethyl)-2H-pyridine

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)C=CC1=NOC(C1C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations