Geometry & MOs

Info

ID:	420610
PubChem CID:	135114317
Reduced:	O2N5C17H21 (1)
Stoich.:	A2B5C17D21 (1)
Weight, g/mol:	410.254258
ΔH_f, kcal/mol:	13.98
Dipole, Da:	2.25
IP(EA), eV:	-9.69(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-(6-amino-2-morpholin-4-ylpyrimidin-4-yl)-N,N-dimethylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-2-amine

Drug info:

PubChemData

Smile

CC1=NON=C1CC(=O)N2CCCC3(C2)CCC4=CN=C(N=C34)C

DOS

IR

Vibrations