Geometry & MOs

Info

ID:	197081
PubChem CID:	78919698
Reduced:	N3O4C11H15 (1)
Stoich.:	A3B4C11D15 (1)
Weight, g/mol:	281.152812
ΔH_f, kcal/mol:	-160.22
Dipole, Da:	5.79
IP(EA), eV:	-8.87(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methoxynaphthalen-1-yl)methyl]-1-(1-methylpyrazol-3-yl)methanamine

Drug info:

PubChemData

Smile

COC(=O)C1CCCN(C1)C(=O)C2=CNC(=O)N2

DOS

IR

Vibrations