Geometry & MOs

Info

ID:	271528
PubChem CID:	103682494
Reduced:	OF2N3C11H19 (1)
Stoich.:	AB2C3D11E19 (1)
Weight, g/mol:	309.241627
ΔH_f, kcal/mol:	-126.16
Dipole, Da:	4.71
IP(EA), eV:	-9.51(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-ethyl-2-[(1-methylpyrrol-2-yl)methylamino]butyl]carbamate

Drug info:

PubChemData

Smile

COCCCCCNCC1=NC=CN1C(F)F

DOS

IR

Vibrations