Geometry & MOs

Info

ID:	172536
PubChem CID:	75522767
Reduced:	NOSC11H23 (1)
Stoich.:	ABCD11E23 (1)
Weight, g/mol:	263.152144
ΔH_f, kcal/mol:	-69.39
Dipole, Da:	3.02
IP(EA), eV:	-8.72(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[2-methyl-N-(2-methylpropanoyl)anilino]propanoate

Drug info:

PubChemData

Smile

CCN(CC)CCSC1CCOC1C

DOS

IR

Vibrations