Geometry & MOs

Info

ID:	340029
PubChem CID:	127262038
Reduced:	N4O6C15H26 (1)
Stoich.:	A4B6C15D26 (1)
Weight, g/mol:	279.121906
ΔH_f, kcal/mol:	-297.43
Dipole, Da:	6.12
IP(EA), eV:	-9.47(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-ynyl N-[(2S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]-prop-2-ynylamino]-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCN([C@@H](C)C(=O)N)C(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CCC(=O)O

DOS

IR

Vibrations