Geometry & MOs

Info

ID:	256336
PubChem CID:	103138571
Reduced:	ON2C7H7 (2)
Stoich.:	AB2C7D7 (2)
Weight, g/mol:	261.209264
ΔH_f, kcal/mol:	-27.96
Dipole, Da:	4.57
IP(EA), eV:	-8.26(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[(5-methyloxolan-2-yl)methyl]-2-phenylbutan-1-amine

Drug info:

PubChemData

Smile

CN1C(=O)CC(C1=O)NC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations