Geometry & MOs

Info

ID:	339831
PubChem CID:	127261840
Reduced:	N3O4C15H21 (1)
Stoich.:	A3B4C15D21 (1)
Weight, g/mol:	337.163771
ΔH_f, kcal/mol:	-165.91
Dipole, Da:	4.49
IP(EA), eV:	-9.74(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(2S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]-(2-hydroxyethyl)amino]-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations