Geometry & MOs

Info

ID:	177785
PubChem CID:	76230217
Reduced:	N2O2C10H11 (2)
Stoich.:	A2B2C10D11 (2)
Weight, g/mol:	367.119988
ΔH_f, kcal/mol:	-78.63
Dipole, Da:	2.44
IP(EA), eV:	-8.47(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methylideneamino]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NCC(=O)NNC(=O)CNC(=O)C=CC2=CC=CC=C2

DOS

IR

Vibrations