Geometry & MOs

Info

ID:	26894
PubChem CID:	803751
Reduced:	BrN2O2H13C16 (1)
Stoich.:	AB2C2D13E16 (1)
Weight, g/mol:	299.08437
ΔH_f, kcal/mol:	-12.56
Dipole, Da:	0.99
IP(EA), eV:	-9.34(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-N-(2,3-dichlorophenyl)propanamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(C=N2)CCOC3=CC(=CC=C3)Br

DOS

IR

Vibrations