Geometry & MOs

Info

ID:	391078
PubChem CID:	135002670
Reduced:	NO2C7H11 (3)
Stoich.:	AB2C7D11 (3)
Weight, g/mol:	378.215472
ΔH_f, kcal/mol:	-269.42
Dipole, Da:	6.61
IP(EA), eV:	-9.47(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(benzylamino)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxobutan-2-yl] butanoate

Drug info:

PubChemData

Smile

C[C@H](C(C(=O)NCC1=CC=CC=C1)O)N(C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations