Geometry & MOs

Info

ID:	305527
PubChem CID:	124958363
Reduced:	N5C18H27 (1)
Stoich.:	A5B18C27 (1)
Weight, g/mol:	384.173231
ΔH_f, kcal/mol:	55.74
Dipole, Da:	2.26
IP(EA), eV:	-8.44(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dimethyl-N-[6-[(2R)-4-[(2-methylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-yl]-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC1=NC=C(C(=N1)[C@@H]2CCCN2CC3=CC=CN3C)CN(C)C

DOS

IR

Vibrations