Geometry & MOs

Info

ID:	427880
PubChem CID:	135164888
Reduced:	SO2N6C24H30 (1)
Stoich.:	AB2C6D24E30 (1)
Weight, g/mol:	357.205242
ΔH_f, kcal/mol:	25.25
Dipole, Da:	2.32
IP(EA), eV:	-9.17(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[(5-methyl-1,2-oxazol-3-yl)methoxy]-5-prop-2-enoxyphenyl]methyl]-1-pyrrolidin-3-ylmethanamine

Drug info:

PubChemData

Smile

C1CC1C2=CSC(=N2)C(=O)NC3=C(C=C(C=C3)CNCC4CCNC4)OCCC5=CN=CN5

DOS

IR

Vibrations