Geometry & MOs

Info

ID:	234668
PubChem CID:	92303278
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	385.236542
ΔH_f, kcal/mol:	-87.22
Dipole, Da:	4.01
IP(EA), eV:	-8.92(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]methyl]-3-methyl-N-[[(2S)-oxolan-2-yl]methyl]butanamide

Drug info:

PubChemData

Smile

CCNC(=O)N(C[C@@H]1CCCO1)CC2=NC=CN2CC3=CC=C(C=C3)OC

DOS

IR

Vibrations