Geometry & MOs

Info

ID:	270349
PubChem CID:	103636166
Reduced:	NOC19H23 (1)
Stoich.:	ABC19D23 (1)
Weight, g/mol:	213.209264
ΔH_f, kcal/mol:	-12.75
Dipole, Da:	2.89
IP(EA), eV:	-8.81(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-methyl-1-(pentan-2-ylamino)cyclohexyl]methanol

Drug info:

PubChemData

Smile

CCC(CC)(CO)NC1C2=CC=CC=C2C3=CC=CC=C13

DOS

IR

Vibrations