Geometry & MOs

Info

ID:	446415
PubChem CID:	135274804
Reduced:	BrNO2C19H28 (1)
Stoich.:	ABC2D19E28 (1)
Weight, g/mol:	327.219829
ΔH_f, kcal/mol:	-119.79
Dipole, Da:	1.68
IP(EA), eV:	-9.49(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1(CCC(C2=C1C(=CC=C2)Br)CCNC(=O)OC(C)(C)C)C

DOS

IR

Vibrations