Geometry & MOs

Info

ID:	446042
PubChem CID:	135271929
Reduced:	NPSO2C10H20 (1)
Stoich.:	ABCD2E10F20 (1)
Weight, g/mol:	177.118735
ΔH_f, kcal/mol:	-113.56
Dipole, Da:	5.4
IP(EA), eV:	-9.01(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-methoxyethylsulfanyl)-3-methylbutan-1-amine

Drug info:

PubChemData

Smile

CCC(P(OC(C)C)OC(C)C)SC#N

DOS

IR

Vibrations