Geometry & MOs

Info

ID:	422686
PubChem CID:	135118246
Reduced:	N4C15H26 (1)
Stoich.:	A4B15C26 (1)
Weight, g/mol:	508.223432
ΔH_f, kcal/mol:	0.72
Dipole, Da:	2.74
IP(EA), eV:	-8.76(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-(2-aminopyrimidin-4-yl)-5-fluoro-22-methoxy-2-oxa-9,14,18-triazatricyclo[18.2.2.13,7]pentacosa-1(22),3,5,7(25),20,23-hexaene-10,19-dione

Drug info:

PubChemData

Smile

CCCC1=CN=C(N=C1NCC(C)N2CCCC2)C

DOS

IR

Vibrations