Geometry & MOs

Info

ID:	196591
PubChem CID:	78851906
Reduced:	NO3C23H27 (1)
Stoich.:	AB3C23D27 (1)
Weight, g/mol:	334.063968
ΔH_f, kcal/mol:	-79.18
Dipole, Da:	3.75
IP(EA), eV:	-9.29(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dichloro-N-cyclopropyl-N-[(3-methylphenyl)methyl]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN(C2CC2)C(=O)CCCOC3=CC=C(C=C3)C(=O)C

DOS

IR

Vibrations