Geometry & MOs

Info

ID:	190573
PubChem CID:	78023324
Reduced:	N3O4C16H21 (1)
Stoich.:	A3B4C16D21 (1)
Weight, g/mol:	385.188923
ΔH_f, kcal/mol:	-87.81
Dipole, Da:	3.95
IP(EA), eV:	-9.56(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-(hydroxymethyl)-2-methoxy-4-phenylmethoxyoxan-3-yl]amino]-1-phenylethanone

Drug info:

PubChemData

Smile

CC1C(OCC(C1OCC2=CC=CC=C2)N=[N+]=[N-])COC(=O)C

DOS

IR

Vibrations