Geometry & MOs

Info

ID:	340042
PubChem CID:	127262051
Reduced:	PN4O6C13H27 (1)
Stoich.:	AB4C6D13E27 (1)
Weight, g/mol:	370.22162
ΔH_f, kcal/mol:	-350.89
Dipole, Da:	7.36
IP(EA), eV:	-9.57(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-[[(2R)-1-[[(2S)-1-amino-1-oxopropan-2-yl]-methylamino]-1-oxopropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCCNCC(=O)N[C@@H](C)C(=O)N([C@@H](C)C(=O)N)[C@H](C)P(=O)(O)O

DOS

IR

Vibrations