Geometry & MOs

Info

ID:	347207
PubChem CID:	127271748
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	394.203862
ΔH_f, kcal/mol:	-115.67
Dipole, Da:	9.16
IP(EA), eV:	-9.25(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-adamantyl)-3-[(1,2-dimethylimidazol-4-yl)sulfonylamino]-N-methylpropanamide

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NCC(=O)N(C)C2C3CC4CC(C3)CC2C4

DOS

IR

Vibrations