Geometry & MOs

Info

ID:	299825
PubChem CID:	117695777
Reduced:	ClNSO2H18C23 (1)
Stoich.:	ABCD2E18F23 (1)
Weight, g/mol:	382.225643
ΔH_f, kcal/mol:	19.44
Dipole, Da:	3.48
IP(EA), eV:	-8.61(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butoxy-N-(2-morpholin-4-yl-2-phenylethyl)benzamide

Drug info:

PubChemData

Smile

CC#CC1=CC2=C(C=C1)C3=C(CCO2)C=C(S3)C(=O)N(C)C4=CC=CC=C4Cl

DOS

IR

Vibrations