Geometry & MOs

Info

ID:	257400
PubChem CID:	103145837
Reduced:	O2N4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	322.225643
ΔH_f, kcal/mol:	-90.92
Dipole, Da:	4.18
IP(EA), eV:	-9.43(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[(3-methylfuran-2-yl)methylamino]cycloheptyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCCCCC1NCC2=CN=CN=C2

DOS

IR

Vibrations