Geometry & MOs

Info

ID:	127804
PubChem CID:	51016291
Reduced:	O3C32H50 (1)
Stoich.:	A3B32C50 (1)
Weight, g/mol:	385.236542
ΔH_f, kcal/mol:	-187.2
Dipole, Da:	5.79
IP(EA), eV:	-9.79(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-N-methyl-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)[C@H]2CC[C@@H]3C[C@@H]2C(=O)O3

DOS

IR

Vibrations