Geometry & MOs

Info

ID:	286799
PubChem CID:	104222422
Reduced:	N5C15H21 (1)
Stoich.:	A5B15C21 (1)
Weight, g/mol:	289.19026
ΔH_f, kcal/mol:	89.57
Dipole, Da:	2.27
IP(EA), eV:	-8.94(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(4-ethyl-3,5-dimethylpyrazol-1-yl)pyrimidin-5-yl]methyl]-2-methoxyethanamine

Drug info:

PubChemData

Smile

CCC1=C(N(N=C1C)C2=NC=C(C=N2)CNC3CC3)C

DOS

IR

Vibrations