Geometry & MOs

Info

ID:	73912
PubChem CID:	48421060
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	308.153621
ΔH_f, kcal/mol:	-135.2
Dipole, Da:	4.07
IP(EA), eV:	-9.53(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropyl-[(4-fluorophenyl)methylcarbamoyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCN(C1CC1)C(=O)NCC2=CC=CO2

DOS

IR

Vibrations