Geometry & MOs

Info

ID:	323522
PubChem CID:	126675185
Reduced:	N3O4C18H27 (1)
Stoich.:	A3B4C18D27 (1)
Weight, g/mol:	270.148061
ΔH_f, kcal/mol:	-182.79
Dipole, Da:	6.03
IP(EA), eV:	-9.5(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-pyridin-3-ylpyrimidin-4-yl)oxycyclohexan-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCC(CC1)COC2=CN=CC(=C2)C(=O)N

DOS

IR

Vibrations