Geometry & MOs

Info

ID:	207388
PubChem CID:	80390697
Reduced:	O2N3C12H21 (1)
Stoich.:	A2B3C12D21 (1)
Weight, g/mol:	221.141579
ΔH_f, kcal/mol:	-81.68
Dipole, Da:	1.37
IP(EA), eV:	-8.14(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylbutan-2-yl 4-amino-2-methylbenzoate

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CC(=O)OC(C)C(C)C)C)N

DOS

IR

Vibrations