Geometry & MOs

Info

ID:	286797
PubChem CID:	104222417
Reduced:	ON5C14H21 (1)
Stoich.:	AB5C14D21 (1)
Weight, g/mol:	273.195346
ΔH_f, kcal/mol:	32.3
Dipole, Da:	3.85
IP(EA), eV:	-8.85(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[[2-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-5-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C)C2=NC=C(C=N2)CNCCOC)C

DOS

IR

Vibrations