Geometry & MOs

Info

ID:	124848
PubChem CID:	50899230
Reduced:	ON2C14H16 (2)
Stoich.:	AB2C14D16 (2)
Weight, g/mol:	361.086101
ΔH_f, kcal/mol:	15.33
Dipole, Da:	2.68
IP(EA), eV:	-8.35(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-4-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-cyclohexylpyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C3=C2C=CC(=C3)CCN4CCN(CC4)C)CC5=CC=C(C=C5)C(=O)NO

DOS

IR

Vibrations