Geometry & MOs

Info

ID:	68297
PubChem CID:	46508134
Reduced:	NSO5C21H23 (1)
Stoich.:	ABC5D21E23 (1)
Weight, g/mol:	327.215806
ΔH_f, kcal/mol:	-172.66
Dipole, Da:	6.67
IP(EA), eV:	-8.71(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[1-(2-methylpropylcarbamoylamino)-1-oxopropan-2-yl]piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)COC(=O)C2(CCCC2)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations