Geometry & MOs

Info

ID:	328703
PubChem CID:	126726640
Reduced:	N2O2C9H16 (1)
Stoich.:	A2B2C9D16 (1)
Weight, g/mol:	273.168856
ΔH_f, kcal/mol:	-101.62
Dipole, Da:	4.86
IP(EA), eV:	-9.41(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3S)-4-amino-3-[[(2S)-2-aminopropanoyl]-methylamino]-4-oxobutanoate

Drug info:

PubChemData

Smile

CC(C)C(=O)N(C)[C@@H]1CCNC1=O

DOS

IR

Vibrations