Geometry & MOs

Info

ID:	415912
PubChem CID:	135088914
Reduced:	ON5C23H25 (1)
Stoich.:	AB5C23D25 (1)
Weight, g/mol:	425.206304
ΔH_f, kcal/mol:	45.2
Dipole, Da:	5.46
IP(EA), eV:	-9.14(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,23R)-15-methoxy-13-oxa-3,8,9,10,21-pentazapentacyclo[19.4.1.18,11.02,23.014,19]heptacosa-9,11(27),14(19),15,17-pentaene-4,20-dione

Drug info:

PubChemData

Smile

CC1=NN(C=C1C(=O)N2CCCC3(C2)CCC4=CN=C(N=C34)C5=CC=CC=C5)C

DOS

IR

Vibrations