Geometry & MOs

Info

ID:	218000
PubChem CID:	85088719
Reduced:	NO5C25H25 (1)
Stoich.:	AB5C25D25 (1)
Weight, g/mol:	419.232125
ΔH_f, kcal/mol:	-132.03
Dipole, Da:	3.05
IP(EA), eV:	-9.66(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-[(2-amino-3-phenylpropanoyl)-methylamino]-N-quinolin-3-ylpentanamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)C(C2C3C(COC(O3)C4=CC=CC=C4)OC(O2)C5=CC=CC=C5)O

DOS

IR

Vibrations