Geometry & MOs

Info

ID:	423146
PubChem CID:	135119008
Reduced:	O2N4C15H26 (1)
Stoich.:	A2B4C15D26 (1)
Weight, g/mol:	319.237211
ΔH_f, kcal/mol:	-92.53
Dipole, Da:	3.38
IP(EA), eV:	-9.26(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-ethyl-4-N-methyl-6-N-[1-(oxolan-2-ylmethyl)piperidin-4-yl]pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C[C@@H]2CN(C[C@H]2O)CC(=O)NC(C)(C)C

DOS

IR

Vibrations