Geometry & MOs

Info

ID:	330061
PubChem CID:	127247048
Reduced:	SN4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	353.232794
ΔH_f, kcal/mol:	71.14
Dipole, Da:	3.49
IP(EA), eV:	-8.59(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-6-[1-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]pyrrolidin-2-yl]pyrazin-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=NC(=CN=C1)C2CCCN2CC3=CSC=C3

DOS

IR

Vibrations