Geometry & MOs

Info

ID:	422672
PubChem CID:	135118224
Reduced:	O6N7C37H47 (1)
Stoich.:	A6B7C37D47 (1)
Weight, g/mol:	299.199762
ΔH_f, kcal/mol:	-192.01
Dipole, Da:	2.57
IP(EA), eV:	-8.99(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-pyridin-2-ylethanamine

Drug info:

PubChemData

Smile

CC[C@H](C)C1C(=O)N[C@H](C(=O)N[C@@H](C(=O)NCCCCN(CC2=CC=C(C=C2)C(=O)N1)C(=O)C3=NC=C(N=C3)C)C)CC4=CC=C(C=C4)OC

DOS

IR

Vibrations