Geometry & MOs

Info

ID:	73908
PubChem CID:	48421019
Reduced:	O2N3C17H27 (1)
Stoich.:	A2B3C17D27 (1)
Weight, g/mol:	392.242356
ΔH_f, kcal/mol:	-71.14
Dipole, Da:	4.39
IP(EA), eV:	-8.49(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[(2-ethoxypyridin-3-yl)carbamoyl-[(1-ethylpyrrolidin-2-yl)methyl]amino]propanoate

Drug info:

PubChemData

Smile

CC1CCC(N1C2CCCN(C2)C(=O)NCC3=CC=CO3)C

DOS

IR

Vibrations