Geometry & MOs

Info

ID:	340095
PubChem CID:	127262104
Reduced:	N3O5C22H33 (1)
Stoich.:	A3B5C22D33 (1)
Weight, g/mol:	453.262757
ΔH_f, kcal/mol:	-214.51
Dipole, Da:	4.68
IP(EA), eV:	-9.57(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(2S)-1-(N-[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]anilino)-4-methyl-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)N(CC=O)[C@@H](CC(C)C)C(=O)N)NC(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations