Geometry & MOs

Info

ID:	313158
PubChem CID:	126612274
Reduced:	ON3H47C58 (1)
Stoich.:	AB3C47D58 (1)
Weight, g/mol:	183.162314
ΔH_f, kcal/mol:	179.97
Dipole, Da:	4.49
IP(EA), eV:	-7.57(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-(1-methylcyclohexyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(C2=CC3=C(C=C2)OC4=C(N3C5=C(C=C(C=C5)C)C)C=C(C=C4)N(C6=CC=C(C=C6)C)C7=CC=CC=C7C8=CC=CC=C8)C9=CC=CC=C9C1=CC=CC=C1

DOS

IR

Vibrations