Geometry & MOs

Info

ID:	235684
PubChem CID:	92710410
Reduced:	N2O2C25H26 (1)
Stoich.:	A2B2C25D26 (1)
Weight, g/mol:	386.199428
ΔH_f, kcal/mol:	-19.58
Dipole, Da:	5.0
IP(EA), eV:	-8.4(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3S)-4-benzyl-2,3-dihydro-1,4-benzoxazin-3-yl]-N-[(4-methylphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)C[C@@H]2COC3=CC=CC=C3N2CC4=CC=CC=C4

DOS

IR

Vibrations