Geometry & MOs

Info

ID:	291729
PubChem CID:	113460665
Reduced:	BrON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	304.05751
ΔH_f, kcal/mol:	-29.48
Dipole, Da:	5.84
IP(EA), eV:	-8.87(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-5-methylphenyl)-N-methyl-2-pyridin-2-ylethanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)Br)C(=O)N2CCC(CC2)N(C)C

DOS

IR

Vibrations