Geometry & MOs

Info

ID:	411242
PubChem CID:	135084055
Reduced:	ClNC15H18 (1)
Stoich.:	ABC15D18 (1)
Weight, g/mol:	203.131014
ΔH_f, kcal/mol:	5.79
Dipole, Da:	4.61
IP(EA), eV:	-8.24(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-methyl-2-(2-methylprop-2-enyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CN1C=C(C2=C1C=CC(=C2)Cl)C3CCCCC3

DOS

IR

Vibrations