Geometry & MOs

Info

ID:	435460
PubChem CID:	135191509
Reduced:	O2N3C6H9 (1)
Stoich.:	A2B3C6D9 (1)
Weight, g/mol:	282.209599
ΔH_f, kcal/mol:	-65.49
Dipole, Da:	2.5
IP(EA), eV:	-9.46(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohexa-1,5-dien-1-yl-N-[(1-methylpiperidin-2-yl)methyl]aniline

Drug info:

PubChemData

Smile

CC1=NC(C=C(N1)C(=O)N)O

DOS

IR

Vibrations