Geometry & MOs

Info

ID:	262411
PubChem CID:	103291921
Reduced:	ClNOC17H26 (1)
Stoich.:	ABCD17E26 (1)
Weight, g/mol:	310.181191
ΔH_f, kcal/mol:	-62.38
Dipole, Da:	1.57
IP(EA), eV:	-9.0(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chloro-6-methoxyphenyl)methyl]-1-propan-2-ylazepan-4-amine

Drug info:

PubChemData

Smile

CC1CC(CC(C1)(C)C)NCC2=C(C=CC=C2Cl)OC

DOS

IR

Vibrations