Geometry & MOs

Info

ID:	286558
PubChem CID:	104171044
Reduced:	NSO2C8H19 (1)
Stoich.:	ABC2D8E19 (1)
Weight, g/mol:	209.108565
ΔH_f, kcal/mol:	-98.35
Dipole, Da:	4.91
IP(EA), eV:	-8.31(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methoxypropylsulfonyl)butan-2-amine

Drug info:

PubChemData

Smile

CC(CS(=O)CC(C)(C)N)OC

DOS

IR

Vibrations