Geometry & MOs

Info

ID:	267187
PubChem CID:	103581236
Reduced:	ON2C17H22 (1)
Stoich.:	AB2C17D22 (1)
Weight, g/mol:	227.152144
ΔH_f, kcal/mol:	-17.12
Dipole, Da:	3.29
IP(EA), eV:	-9.08(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(2,3-dimethyloxolan-3-yl)amino]-2-methylbut-2-enoate

Drug info:

PubChemData

Smile

CC1C(CCO1)(C)NCC2=CC(=NC3=CC=CC=C32)C

DOS

IR

Vibrations