Geometry & MOs

Info

ID:	69018
PubChem CID:	46515643
Reduced:	SO2N5H21C24 (1)
Stoich.:	AB2C5D21E24 (1)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	51.43
Dipole, Da:	4.29
IP(EA), eV:	-9.14(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-2-carbonyl)-N-(4-methylcyclohexyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC2=NC(=NC(=C12)C)C3=CC=CO3)C(=O)NC(C)C4=CC=C(C=C4)N5C=CN=C5

DOS

IR

Vibrations