Geometry & MOs

Info

ID:	202376
PubChem CID:	79664954
Reduced:	ON4C14H24 (1)
Stoich.:	AB4C14D24 (1)
Weight, g/mol:	354.10552
ΔH_f, kcal/mol:	-23.58
Dipole, Da:	4.76
IP(EA), eV:	-8.63(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-cyclopropyl-N-methyl-2-(4-propan-2-ylmorpholin-2-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(C)N1CCOC(C1)C(C2=C(C=CN=C2)N)NC

DOS

IR

Vibrations