Geometry & MOs

Info

ID:	435593
PubChem CID:	135191888
Reduced:	ON3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	321.168856
ΔH_f, kcal/mol:	5.18
Dipole, Da:	6.33
IP(EA), eV:	-9.39(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-[2-(dimethylamino)-4-(morpholine-4-carbonyl)phenoxy]propanal

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=CC(=N2)C(=O)NC)C

DOS

IR

Vibrations