Geometry & MOs

Info

ID:	126655
PubChem CID:	50972165
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	340.226312
ΔH_f, kcal/mol:	-15.35
Dipole, Da:	7.57
IP(EA), eV:	-9.11(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dimethylphenyl)-2-[[1-[(3,5-dimethylpyrazol-1-yl)methyl]cyclopropyl]methylamino]acetamide

Drug info:

PubChemData

Smile

CC1CNC(=O)CCN1CC2=CC(=C(C=C2)OC)CN3C=NC=N3

DOS

IR

Vibrations