Geometry & MOs

Info

ID:	200063
PubChem CID:	79341548
Reduced:	ON2C16H20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	13.73
Dipole, Da:	2.79
IP(EA), eV:	-8.74(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-methoxy-4-[3-(2-methoxyethylamino)prop-1-enyl]phenoxy]acetonitrile

Drug info:

PubChemData

Smile

CC(C)NCC(=CC1=CC=C(O1)C2=CN=CC=C2)C

DOS

IR

Vibrations