Geometry & MOs

Info

ID:	190578
PubChem CID:	78023329
Reduced:	NO5C24H29 (1)
Stoich.:	AB5C24D29 (1)
Weight, g/mol:	336.168522
ΔH_f, kcal/mol:	-172.87
Dipole, Da:	3.14
IP(EA), eV:	-9.07(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2-benzamido-3-hydroxypropanoyl)amino]-4-methylpentanoate

Drug info:

PubChemData

Smile

CC1C(C(CC(O1)COC(=O)C)OCC2=CC=CC=C2)NCC(=O)C3=CC=CC=C3

DOS

IR

Vibrations