Geometry & MOs

Info

ID:	414477
PubChem CID:	135087435
Reduced:	SN2O2C20H22 (1)
Stoich.:	AB2C2D20E22 (1)
Weight, g/mol:	494.239001
ΔH_f, kcal/mol:	-32.39
Dipole, Da:	7.39
IP(EA), eV:	-9.01(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(14R)-20-(1H-imidazole-5-carbonyl)-8,14-dimethyl-5-oxa-1,13,16,20,23,24-hexazatricyclo[20.2.1.06,11]pentacosa-6(11),7,9,22(25),23-pentaene-12,15-dione

Drug info:

PubChemData

Smile

C1CN(CCN(C1)C(=O)C2=CSC=C2)C(=O)C3CCC4=CC=CC=C34

DOS

IR

Vibrations