Geometry & MOs

Info

ID:	74123
PubChem CID:	48421491
Reduced:	O3N4C14H22 (1)
Stoich.:	A3B4C14D22 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-86.07
Dipole, Da:	6.83
IP(EA), eV:	-8.8(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropyl-[(3-methylpyridin-2-yl)carbamoyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCN(C1CC1)C(=O)NC2=CC(=NN2C)C

DOS

IR

Vibrations