Geometry & MOs

Info

ID:	423643
PubChem CID:	135119890
Reduced:	O3N4C19H28 (1)
Stoich.:	A3B4C19D28 (1)
Weight, g/mol:	483.248169
ΔH_f, kcal/mol:	-64.8
Dipole, Da:	4.19
IP(EA), eV:	-8.99(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-methoxy-3,12-dioxa-6,15,16,17,23-pentazapentacyclo[21.2.2.28,11.11,4.115,18]hentriaconta-8,10,16,18(28),29-pentaene-7,22-dione

Drug info:

PubChemData

Smile

CCC1=C(N(N=C1C)CC(=O)N2C[C@H]([C@H](C2)OC)CC3=CC(=NO3)C)C

DOS

IR

Vibrations