Geometry & MOs

Info

ID:	363419
PubChem CID:	127311222
Reduced:	O2N3C24H35 (1)
Stoich.:	A2B3C24D35 (1)
Weight, g/mol:	385.203528
ΔH_f, kcal/mol:	-102.53
Dipole, Da:	3.51
IP(EA), eV:	-8.4(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)NC2=CC=C(C=C2)CCN3CCCC3)C(=O)N4CCCC4

DOS

IR

Vibrations