Geometry & MOs

Info

ID:	237344
PubChem CID:	92718788
Reduced:	NOC9H10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	299.188529
ΔH_f, kcal/mol:	-45.34
Dipole, Da:	4.51
IP(EA), eV:	-8.81(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-[4-[(2R)-butan-2-yl]phenyl]-(2,6-dimethoxyphenyl)methanamine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC[C@@H](C2=CC3=C(C=C2)NC(=O)C3)N

DOS

IR

Vibrations