Geometry & MOs

Info

ID:	335820
PubChem CID:	127254682
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	484.195799
ΔH_f, kcal/mol:	11.03
Dipole, Da:	8.68
IP(EA), eV:	-8.04(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[3-(2-amino-2-oxoethoxy)-4-methoxyphenyl]-3-[4-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]-6-methyl-2-oxopyridin-3-yl]propanoate

Drug info:

PubChemData

Smile

CC1=CC=C(N1CC(=O)NCC2(CCCCC2)CC3=NN=C4N3C=CC=C4)C

DOS

IR

Vibrations