Geometry & MOs

Info

ID:	420025
PubChem CID:	135110808
Reduced:	ClN2O2C18H25 (1)
Stoich.:	AB2C2D18E25 (1)
Weight, g/mol:	309.184112
ΔH_f, kcal/mol:	-110.19
Dipole, Da:	7.36
IP(EA), eV:	-8.5(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(2S,6R)-2-cyclopropyl-6-phenylmorpholin-4-yl]methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC[C@]1(CCC[C@H]2[C@@H]1CN(C2)C(=O)NC3=CC(=C(C=C3)C)Cl)O

DOS

IR

Vibrations