Geometry & MOs

Info

ID:	197868
PubChem CID:	79007337
Reduced:	BrNC16H18 (1)
Stoich.:	ABC16D18 (1)
Weight, g/mol:	253.18305
ΔH_f, kcal/mol:	28.28
Dipole, Da:	2.66
IP(EA), eV:	-8.24(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-(1-phenylbutan-2-yl)aniline

Drug info:

PubChemData

Smile

CCC(CC1=CC=CC=C1)NC2=CC=CC=C2Br

DOS

IR

Vibrations