Geometry & MOs

Info

ID:	391203
PubChem CID:	135003523
Reduced:	N3O4C20H25 (1)
Stoich.:	A3B4C20D25 (1)
Weight, g/mol:	306.157957
ΔH_f, kcal/mol:	-150.08
Dipole, Da:	6.77
IP(EA), eV:	-8.25(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-(2-nitrophenoxy)butanamide

Drug info:

PubChemData

Smile

CCOC(=O)[C@H]1[C@@H]2CC(=CN([C@@H]2C3=C(N1)C=CC(=C3)NC(=O)C)C)C(=O)C

DOS

IR

Vibrations