Geometry & MOs

Info

ID:	296281
PubChem CID:	117565521
Reduced:	N2O3C11H20 (1)
Stoich.:	A2B3C11D20 (1)
Weight, g/mol:	263.152144
ΔH_f, kcal/mol:	-148.16
Dipole, Da:	3.88
IP(EA), eV:	-8.88(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2-ethyl-6-methylphenyl)carbamoyl]butanoate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N1CCN(CC1)C)C(=O)O

DOS

IR

Vibrations