Geometry & MOs

Info

ID:	286831
PubChem CID:	104222562
Reduced:	ON6C14H20 (1)
Stoich.:	AB6C14D20 (1)
Weight, g/mol:	260.138559
ΔH_f, kcal/mol:	46.94
Dipole, Da:	8.2
IP(EA), eV:	-9.13(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1-[5-(methylaminomethyl)pyrimidin-2-yl]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)NCC1=CN=C(N=C1)N2C=CC(=N2)C(=O)N(C)C

DOS

IR

Vibrations