Geometry & MOs

Info

ID:	272468
PubChem CID:	103743574
Reduced:	NOC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	273.172879
ΔH_f, kcal/mol:	-55.54
Dipole, Da:	1.79
IP(EA), eV:	-8.99(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methyloxan-4-yl)methyl]-1-(2-prop-2-ynoxyphenyl)methanamine

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)CNCC2(CCOCC2)C

DOS

IR

Vibrations