Geometry & MOs

Info

ID:	289014
PubChem CID:	104331140
Reduced:	ON3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	278.163043
ΔH_f, kcal/mol:	-7.83
Dipole, Da:	3.75
IP(EA), eV:	-8.46(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(ethylamino)-2-methylphenyl]-[2-(hydroxymethyl)morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)CN(C)C(=O)C2=C(C=C(C=C2)NC)C

DOS

IR

Vibrations