Geometry & MOs

Info

ID:	391673
PubChem CID:	135008081
Reduced:	NOC20H25 (1)
Stoich.:	ABC20D25 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	3.41
Dipole, Da:	2.18
IP(EA), eV:	-8.0(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(4-methoxyphenyl)-1-(pyridine-2-carbonylamino)cyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

CC1(CC1C2=C3CCCCC3=C(N2C)OC)C4=CC=CC=C4

DOS

IR

Vibrations