Geometry & MOs

Info

ID:	282679
PubChem CID:	103936089
Reduced:	N4C15H22 (1)
Stoich.:	A4B15C22 (1)
Weight, g/mol:	319.225977
ΔH_f, kcal/mol:	45.66
Dipole, Da:	6.31
IP(EA), eV:	-8.61(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[(1-methylazepan-4-yl)amino]phenyl]carbamate

Drug info:

PubChemData

Smile

CCCC(CC)NC1=CC=C(C=C1)CN2C=NC=N2

DOS

IR

Vibrations