Geometry & MOs

Info

ID:	339081
PubChem CID:	127260333
Reduced:	OC6H6 (4)
Stoich.:	AB6C6 (4)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	-117.15
Dipole, Da:	2.01
IP(EA), eV:	-8.86(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(pyrrolidine-2-carbonyl)amino]ethyl benzoate

Drug info:

PubChemData

Smile

CCC(COC(=O)C1=CC=CC=C1)C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O

DOS

IR

Vibrations