Geometry & MOs

Info

ID:	315796
PubChem CID:	126628797
Reduced:	NO3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	653.146234
ΔH_f, kcal/mol:	-140.12
Dipole, Da:	1.77
IP(EA), eV:	-10.01(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trichloroethyl (3S)-1-[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoyl]diazinane-3-carboxylate

Drug info:

PubChemData

Smile

C/C=C(\C)/C(=O)N1C(COC1=O)C(C)C

DOS

IR

Vibrations