Geometry & MOs

Info

ID:	370215
PubChem CID:	127337748
Reduced:	O2S2N3C18H33 (1)
Stoich.:	A2B2C3D18E33 (1)
Weight, g/mol:	368.257612
ΔH_f, kcal/mol:	-104.83
Dipole, Da:	3.88
IP(EA), eV:	-8.45(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethylimidazol-1-yl)-N-[2-methyl-1-(2-methylphenyl)propyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1C(S(=O)CCN1C(=O)NCC2(CCCCC2)N3CCSCC3)C

DOS

IR

Vibrations