Geometry & MOs

Info

ID:	197761
PubChem CID:	78992461
Reduced:	BrSN2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	304.072907
ΔH_f, kcal/mol:	20.05
Dipole, Da:	2.58
IP(EA), eV:	-8.42(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]morpholine-2-carboxylate

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1CC3=C(C=CS3)Br

DOS

IR

Vibrations