Geometry & MOs

Info

ID:	281218
PubChem CID:	103911519
Reduced:	NO3C11H23 (1)
Stoich.:	AB3C11D23 (1)
Weight, g/mol:	283.133907
ΔH_f, kcal/mol:	-158.06
Dipole, Da:	3.02
IP(EA), eV:	-8.98(1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(4-chlorophenyl)-cyclopropylmethyl]amino]-1-methoxybutan-2-ol

Drug info:

PubChemData

Smile

CC1CC(CCO1)NCCC(COC)O

DOS

IR

Vibrations