Geometry & MOs

Info

ID:	151238
PubChem CID:	53790938
Reduced:	NO4C48H49 (1)
Stoich.:	AB4C48D49 (1)
Weight, g/mol:	294.157957
ΔH_f, kcal/mol:	-61.53
Dipole, Da:	3.72
IP(EA), eV:	-8.81(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(C(C1)OCC2=CC3=CC=CC=C3C=C2)C4=CC=C(C=C4)CCOC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

DOS

IR

Vibrations