Geometry & MOs

Info

ID:	5082
PubChem CID:	12561
Reduced:	NC9H13 (1)
Stoich.:	AB9C13 (1)
Weight, g/mol:	135.104799
ΔH_f, kcal/mol:	4.51
Dipole, Da:	1.86
IP(EA), eV:	-8.3(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propan-2-ylaniline

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1N

DOS

IR

Vibrations