Geometry & MOs

Info

ID:	423836
PubChem CID:	135120407
Reduced:	O5N7C36H45 (1)
Stoich.:	A5B7C36D45 (1)
Weight, g/mol:	369.194008
ΔH_f, kcal/mol:	-162.17
Dipole, Da:	5.84
IP(EA), eV:	-9.3(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(hydroxymethyl)oxan-4-yl]methyl]-N-methyl-4-(3-methylphenoxy)benzamide

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)NCCCCN(CC2=CC=C(C=C2)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CC3=CC=CC=C3)C(=O)C4=NC(=CC=C4)N

DOS

IR

Vibrations