Geometry & MOs

Info

ID:	445674
PubChem CID:	135268870
Reduced:	N5C25H33 (1)
Stoich.:	A5B25C33 (1)
Weight, g/mol:	490.212867
ΔH_f, kcal/mol:	106.25
Dipole, Da:	3.63
IP(EA), eV:	-8.23(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[2-fluoro-4-methyl-5-[[3-(2-nitrosoethoxy)-1,6-dihydropyridazin-6-yl]methyl]phenyl]quinazolin-7-yl]morpholine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=C(N=C2C(C)C)N(C)C=C)C(=C)N(C)CC3=CC=NC3

DOS

IR

Vibrations