Geometry & MOs

Info

ID:	285679
PubChem CID:	104118268
Reduced:	O2N3C15H21 (1)
Stoich.:	A2B3C15D21 (1)
Weight, g/mol:	257.152812
ΔH_f, kcal/mol:	-31.01
Dipole, Da:	5.05
IP(EA), eV:	-8.59(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)-1,3-oxazol-4-yl]methanamine

Drug info:

PubChemData

Smile

CC(CC1=CC=CC=C1OC)N(C)C2=NC(=CO2)CN

DOS

IR

Vibrations