Geometry & MOs

Info

ID:	212956
PubChem CID:	81062394
Reduced:	NSO4C14H19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	286.225643
ΔH_f, kcal/mol:	-139.27
Dipole, Da:	9.15
IP(EA), eV:	-9.49(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(cyclopropylamino)-2-methyl-4-[methyl(2-propan-2-yloxyethyl)amino]butanoate

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C1=C(C=CS1)/C=C/C(=O)O

DOS

IR

Vibrations