Geometry & MOs

Info

ID:	164058
PubChem CID:	74381700
Reduced:	N4O4C23H34 (1)
Stoich.:	A4B4C23D34 (1)
Weight, g/mol:	334.092912
ΔH_f, kcal/mol:	-174.16
Dipole, Da:	5.46
IP(EA), eV:	-8.43(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-hydroxy-13-(trifluoromethyl)-6,7-diazapentacyclo[13.2.1.01,12.03,11.04,8]octadeca-3(11),4(8),5,9,12-pentaen-2-one

Drug info:

PubChemData

Smile

CCC1CC(NN1)C(=O)NC2=CC=C(C=C2)C3CCC(CC3)C(=O)NC(C)(C)C(=O)O

DOS

IR

Vibrations