Geometry & MOs

Info

ID:	138199
PubChem CID:	52327201
Reduced:	O2N6H22C23 (1)
Stoich.:	A2B6C22D23 (1)
Weight, g/mol:	329.199094
ΔH_f, kcal/mol:	23.91
Dipole, Da:	4.54
IP(EA), eV:	-8.63(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(cyclohexanecarbonyl)piperidin-4-yl]-(4-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)C)C2=CC=C(C=C2)NC(=O)C3=CC4=NC(=C(N=C4C=C3)C)C

DOS

IR

Vibrations