Geometry & MOs

Info

ID:	259573
PubChem CID:	103168492
Reduced:	NOC18H29 (1)
Stoich.:	ABC18D29 (1)
Weight, g/mol:	297.149557
ΔH_f, kcal/mol:	-55.6
Dipole, Da:	1.49
IP(EA), eV:	-9.05(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-methoxyphenyl)-3-(3-ethoxycyclobutyl)propan-2-amine

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(CC2=CC=C(C=C2)C(C)C)N

DOS

IR

Vibrations