Geometry & MOs

Info

ID:	188791
PubChem CID:	77767080
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	780.32581
ΔH_f, kcal/mol:	-96.65
Dipole, Da:	4.8
IP(EA), eV:	-9.33(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[(4-methoxycarbonylbenzoyl)amino]-3-phenylpropanoyl]amino]propanoic acid;[2-oxo-3-(2,4,6-trimethylbenzoyl)oxypropyl] 2,4,6-trimethylbenzoate

Drug info:

PubChemData

Smile

CCC(CC(=O)N(CCC1=CC=CC=C1)C(=O)CC)N

DOS

IR

Vibrations