Geometry & MOs

Info

ID:	360853
PubChem CID:	127301507
Reduced:	SN3O4C12H21 (1)
Stoich.:	AB3C4D12E21 (1)
Weight, g/mol:	344.151826
ΔH_f, kcal/mol:	-110.85
Dipole, Da:	3.31
IP(EA), eV:	-8.95(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[4-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]-1,4-diazepan-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CS(=O)(=O)NC(C)CN2CCOCC2

DOS

IR

Vibrations