Geometry & MOs

Info

ID:	224323
PubChem CID:	85341583
Reduced:	N2O4C17H26 (1)
Stoich.:	A2B4C17D26 (1)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-153.61
Dipole, Da:	2.18
IP(EA), eV:	-9.14(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-N-[2-(hydroxymethyl)cyclohexyl]-4H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1(OCC(O1)C(CC2=CC=CC=C2)N(C(=O)OC)N(C)C)C

DOS

IR

Vibrations