Geometry & MOs

Info

ID:	282317
PubChem CID:	103922115
Reduced:	BrNO2C17H20 (1)
Stoich.:	ABC2D17E20 (1)
Weight, g/mol:	326.256943
ΔH_f, kcal/mol:	-26.75
Dipole, Da:	3.09
IP(EA), eV:	-9.3(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-cyclopropyl-2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]ethyl]carbamate

Drug info:

PubChemData

Smile

CC(C1=CC2=C(O1)C=CC(=C2)Br)NC3CCOC3C4CC4

DOS

IR

Vibrations