Geometry & MOs

Info

ID:	336669
PubChem CID:	127255676
Reduced:	ClO7N8C25H41 (1)
Stoich.:	AB7C8D25E41 (1)
Weight, g/mol:	305.102337
ΔH_f, kcal/mol:	-287.46
Dipole, Da:	5.48
IP(EA), eV:	-9.59(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-fluoro-9-phenylcarbazol-3-yl)boronic acid

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)OC(C)(C)C.Cl

DOS

IR

Vibrations