Geometry & MOs

Info

ID:	349425
PubChem CID:	127275212
Reduced:	O2N3C19H25 (1)
Stoich.:	A2B3C19D25 (1)
Weight, g/mol:	313.179027
ΔH_f, kcal/mol:	-13.53
Dipole, Da:	4.95
IP(EA), eV:	-9.09(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methyl-1,2-oxazol-5-yl)-2-(4-phenylazepan-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)NC(=O)C(C)N2CCCC(CC2)C3=CC=CC=C3

DOS

IR

Vibrations