Geometry & MOs

Info

ID:	305936
PubChem CID:	124975191
Reduced:	ON7C17H23 (1)
Stoich.:	AB7C17D23 (1)
Weight, g/mol:	341.196408
ΔH_f, kcal/mol:	24.25
Dipole, Da:	1.5
IP(EA), eV:	-8.9(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-2-[3-[(4,6-dimethylpyrimidin-2-yl)amino]pyrazin-2-yl]pyrrolidin-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)NC2=NC=CN=C2[C@H]3CCCN3CC(=O)NC)C

DOS

IR

Vibrations