Geometry & MOs

Info

ID:	283052
PubChem CID:	103955731
Reduced:	ON4C11H20 (1)
Stoich.:	AB4C11D20 (1)
Weight, g/mol:	405.168856
ΔH_f, kcal/mol:	-29.21
Dipole, Da:	4.98
IP(EA), eV:	-9.28(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethyl-1-methylpyrazol-4-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)acetic acid

Drug info:

PubChemData

Smile

CCC1=NN(C=C1CNC(=O)[C@@H](CC)N)C

DOS

IR

Vibrations