Geometry & MOs

Info

ID:	75786
PubChem CID:	48423978
Reduced:	NO2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	299.209658
ΔH_f, kcal/mol:	-147.22
Dipole, Da:	3.54
IP(EA), eV:	-9.22(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 7-[2-(cyclopropylmethoxy)propanoylamino]heptanoate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)OC2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NC(=O)OC

DOS

IR

Vibrations