Geometry & MOs

Info

ID:	272466
PubChem CID:	103743571
Reduced:	NBr2O2C16H23 (1)
Stoich.:	AB2C2D16E23 (1)
Weight, g/mol:	253.240565
ΔH_f, kcal/mol:	-76.25
Dipole, Da:	4.73
IP(EA), eV:	-9.14(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methyloxan-4-yl)methyl]-4-propan-2-ylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1Br)Br)CNCC2(CCOCC2)C

DOS

IR

Vibrations