Geometry & MOs

Info

ID:	164303
PubChem CID:	74382795
Reduced:	N4O5C26H28 (1)
Stoich.:	A4B5C26D28 (1)
Weight, g/mol:	300.102941
ΔH_f, kcal/mol:	-132.8
Dipole, Da:	7.41
IP(EA), eV:	-8.97(-2.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

13-chloro-14-methoxy-6,7-diazapentacyclo[13.2.1.01,12.03,11.04,8]octadeca-3(11),4(8),5,9,12-pentaene

Drug info:

PubChemData

Smile

CC(C)(C(=O)O)NC(=O)C1CCC(CC1)C2=CC=C(C=C2)NC(=O)C3C(=O)N=C4C=CC=CC4=N3

DOS

IR

Vibrations